2-amino-5-chloro-N-(5-oxopyrrolidin-3-yl)pyridine-4-carboxamide

C10H11ClN4O2 — CID 106197793

IUPAC2-amino-5-chloro-N-(5-oxopyrrolidin-3-yl)pyridine-4-carboxamide
SMILESNc1cc(C(=O)NC2CNC(=O)C2)c(Cl)cn1
InChIInChI=1S/C10H11ClN4O2/c11-7-4-13-8(12)2-6(7)10(17)15-5-1-9(16)14-3-5/h2,4-5H,1,3H2,(H2,12,13)(H,14,16)(H,15,17)
InChIKeyFYBCVLNFNMVOHJ-UHFFFAOYSA-N
MW254.68 g/mol
LogP-0.06
Rot. Bonds2

About 2-amino-5-chloro-N-(5-oxopyrrolidin-3-yl)pyridine-4-carboxamide

2-amino-5-chloro-N-(5-oxopyrrolidin-3-yl)pyridine-4-carboxamide (PubChem CID 106197793) has the molecular formula C10H11ClN4O2 and a molecular weight of 254.68 g/mol. Its IUPAC name is 2-amino-5-chloro-N-(5-oxopyrrolidin-3-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-5-chloro-N-(5-oxopyrrolidin-3-yl)pyridine-4-carboxamide
PubChem CID106197793
Molecular FormulaC10H11ClN4O2
Molecular Weight254.68 g/mol
Exact Mass254.06
IUPAC Name2-amino-5-chloro-N-(5-oxopyrrolidin-3-yl)pyridine-4-carboxamide
SMILESNc1cc(C(=O)NC2CNC(=O)C2)c(Cl)cn1
InChIInChI=1S/C10H11ClN4O2/c11-7-4-13-8(12)2-6(7)10(17)15-5-1-9(16)14-3-5/h2,4-5H,1,3H2,(H2,12,13)(H,14,16)(H,15,17)
InChIKeyFYBCVLNFNMVOHJ-UHFFFAOYSA-N
XLogP-0.06
TPSA97.11 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.68
LogP ≤ 5-0.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-5-chloro-N-(5-oxopyrrolidin-3-yl)pyridine-4-carboxamide?
The IUPAC name of 2-amino-5-chloro-N-(5-oxopyrrolidin-3-yl)pyridine-4-carboxamide (CID 106197793) is 2-amino-5-chloro-N-(5-oxopyrrolidin-3-yl)pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-5-chloro-N-(5-oxopyrrolidin-3-yl)pyridine-4-carboxamide?
The canonical SMILES for 2-amino-5-chloro-N-(5-oxopyrrolidin-3-yl)pyridine-4-carboxamide is Nc1cc(C(=O)NC2CNC(=O)C2)c(Cl)cn1.
What is the InChIKey of 2-amino-5-chloro-N-(5-oxopyrrolidin-3-yl)pyridine-4-carboxamide?
The InChIKey is FYBCVLNFNMVOHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN4O2/c11-7-4-13-8(12)2-6(7)10(17)15-5-1-9(16)14-3-5/h2,4-5H,1,3H2,(H2,12,13)(H,14,16)(H,15,17).
What are the key properties of 2-amino-5-chloro-N-(5-oxopyrrolidin-3-yl)pyridine-4-carboxamide?
2-amino-5-chloro-N-(5-oxopyrrolidin-3-yl)pyridine-4-carboxamide has a molecular weight of 254.68 g/mol, XLogP of -0.06, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-chloro-N-(5-oxopyrrolidin-3-yl)pyridine-4-carboxamide is sourced from PubChem (CID 106197793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).